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About This Item
Linear Formula:
HOC6H4CO2C2H5
CAS Number:
Molecular Weight:
166.17
PubChem Substance ID:
UNSPSC Code:
41116107
Beilstein/REAXYS Number:
1101972
MDL number:
eCl@ss:
39024522
grade
reagent grade
Quality Level
product line
Vetec™
assay
99%
bp
297-298 °C (lit.)
mp
114-117 °C (lit.)
format
neat
SMILES string
CCOC(=O)c1ccc(O)cc1
InChI
1S/C9H10O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3
InChI key
NUVBSKCKDOMJSU-UHFFFAOYSA-N
Other Notes
Find a digital Reference Material for this product availableon our online platform ChemisTwin® for NMR. You can use thisdigital equivalent on ChemisTwin® for your sample identityconfirmation and compound quantification (with digital external standard). AnNMR spectrum of this substance can be viewed and an online comparison againstyour sample can be performed with a few mouseclicks. Learn more here and start your free trial.
Legal Information
Vetec is a trademark of Merck KGaA, Darmstadt, Germany
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Storage Class
11 - Combustible Solids
wgk
WGK 1
flash_point_f
Not applicable
flash_point_c
Not applicable
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Maw-Rong Lee et al.
Journal of chromatography. A, 1120(1-2), 244-251 (2006-03-04)
This study evaluated supercritical fluid extraction (SFE) combined with liquid chromatography-mass spectrometry (LC-MS) to determine trace preservatives and antioxidants including methylparaben (MP), ethylparaben (EP), propylparaben (PP), butylparaben (BP), butylated hydroxyanisole (BHA), butylated hydroxytoluene (BHT), alpha-tocopherol (alpha-t) and alpha-tocopherol acetate (alpha-ta)
K L Pedersen et al.
Pharmacology & toxicology, 86(3), 110-113 (2001-02-07)
The widely used phenolic preservatives ethylparaben, propylparaben, butylparaben and their common metabolite p-hydroxybenzoic acid were tested for their ability to evoke an oestrogenic response in vivo. Yolk protein induction in sexually immature rainbow trout was used as an oestrogen-specific endpoint
Suzanne Abbas et al.
Drug metabolism and pharmacokinetics, 25(6), 568-577 (2010-10-12)
Parabens (alkyl esters of 4-hydroxybenzoic acid) are widely used as preservatives in drugs, cosmetic products, and foodstuffs. Safety concerns have recently increased due to the potential health risks associated to exposure to large amounts of these substances. Biotransformation of parabens
Global Trade Item Number
| SKU | GTIN |
|---|---|
| V900315-1G | 04061823672139 |
| V900315-250G | 04061832851747 |
| V900315-500G | 04061832851754 |